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Substance Name: Benzo(e)pyrene-4-acetic acid
RN: 113779-20-7
InChIKey: CFSBBABQWJROBP-UHFFFAOYSA-N

Molecular Formula

  • C22-H14-O2

Molecular Weight

  • 310.351
 
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Names and Synonyms

  • Benzo(e)pyrene-4-acetic acid

Registry Numbers

CAS Registry Number

  • 113779-20-7

System Generated Number

  • 0113779207

Structure Descriptors

InChI

1S/C22H14O2/c23-20(24)12-14-11-13-5-3-9-18-16-6-1-2-7-17(16)19-10-4-8-15(14)22(19)21(13)18/h1-11H,12H2,(H,23,24)

InChIKey

CFSBBABQWJROBP-UHFFFAOYSA-N

Smiles

c1ccc2c3c(c4cccc5cc(c1c2c45)CC(=O)O)cccc3